methyl (3E)-3-methoxyimino-3-(1-methylpyridin-1-ium-3-yl)propanoate iodide

Systemtic Name: methyl (3E)-3-methoxyimino-3-(1-methylpyridin-1-ium-3-yl)propanoate iodide Openeye Name: methyl (3E)-3-methoxyimino-3-(1-methylpyridin-1-ium-3-yl)propanoate iodide CAS Name: (3E)-3-methoxyimino-3-(1-methyl-3-pyridin-1-iumyl)propanoic acid methyl ester iodide IUPAC Name: methyl (3E)-3-methoxyimino-3-(1-methylpyridin-1-ium-3-yl)propanoate iodide Traditional Name: (3E)-3-methyloximino-3-(1-methylpyridin-1-ium-3-yl)propionic acid methyl ester iodide Formula: C11H15IN2O3 MolecularWeight: 350.15287

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1)C(=NOC)CC(=O)OC.[I-]

Isomeric SMILES

C[N+]1=CC=CC(=C1)/C(=N/OC)/CC(=O)OC.[I-]

InChI

InChI=1S/C11H15N2O3.HI/c1-13-6-4-5-9(8-13)10(12-16-3)7-11(14)15-2;/h4-6,8H,7H2,1-3H3;1H/q+1;/p-1/b12-10+;